⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL15706625 | 0.79 | SLC6A4 (0.43) | — | |
| SCHEMBL12213154 | 0.76 | — | — | |
| SCHEMBL21962268 | 0.74 | — | — | |
| SCHEMBL18901137 | 0.70 | LMNA (0.38) | — | |
| SCHEMBL3295120 | 0.69 | LTA4H (0.39) | — | |
| SCHEMBL13889122 | 0.68 | ADRB2 (0.37) | — | |
| Formic Acid SCHEMBL29148169 | 0.67 | SLC6A4 (0.39) | — | |
| SCHEMBL2052969 | 0.67 | — | — | |
| SCHEMBL30590802 | 0.65 | MAPT (0.37) | — | |
| SCHEMBL10692665 | 0.64 | HTR2A (0.47) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20160152628-A1 | TRICYCLIC PYRIDO-CARBOXAMIDE DERIVATIVES AS ROCK INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2016-06-02 | — | — | US | disclosed |
| CN-101926017-B | Solution processable organic semiconductors based on anthracene | 3M INNOVATIVE PROPERTIES CO | 2013-09-25 | — | — | CN | disclosed |
| US-8178873-B2 | Solution processable organic semiconductors | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2012-05-15 | — | — | US | disclosed |
| CN-101926017-A | Solution processable organic semiconductors based on anthracene | 3M INNOVATIVE PROPERTIES CO | 2010-12-22 | — | — | CN | disclosed |
| US-20100270542-A1 | Solution Processable Organic Semiconductors | 3M INNOVATIVE PROPERTIES COMPANY | 2010-10-28 | — | — | US | disclosed |
| EP-2232606-A1 | SOLUTION PROCESSABLE ORGANIC SEMICONDUCTORS BASED ON ANTHRACENE | 3M Innovative Properties Company (US) | 2010-09-29 | — | — | EP | disclosed |
| WO-2009079150-A1 | SOLUTION PROCESSABLE ORGANIC SEMICONDUCTORS BASED ON ANTHRACENE | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2009-06-25 | — | — | WO | disclosed |